Geometry & MOs

Info

ID:	173067
PubChem CID:	75592436
Reduced:	N2O2C10H11 (2)
Stoich.:	A2B2C10D11 (2)
Weight, g/mol:	305.210327
ΔH_f, kcal/mol:	-101.37
Dipole, Da:	3.06
IP(EA), eV:	-9.13(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-hydroxybutan-2-yl)-3-methyl-N-[(2-methylphenyl)methyl]pyrazolidine-4-carboxamide

Drug info:

PubChemData

Smile

CCC1(C2C(C(N1)C3=CC(=CC=C3)N4C=CC=N4)C(=O)N(C2=O)C)C(=O)OC

DOS

IR

Vibrations